ethyl 4-[(5-bromanyl-2-phenylmethoxy-phenyl)methylamino]-3-ethoxy-benzoate

Systemtic Name: ethyl 4-[(5-bromanyl-2-phenylmethoxy-phenyl)methylamino]-3-ethoxy-benzoate Openeye Name: ethyl 4-[(2-benzyloxy-5-bromo-phenyl)methylamino]-3-ethoxy-benzoate CAS Name: 4-[(5-bromo-2-phenylmethoxyphenyl)methylamino]-3-ethoxybenzoic acid ethyl ester IUPAC Name: ethyl 4-[(5-bromo-2-phenylmethoxyphenyl)methylamino]-3-ethoxybenzoate Traditional Name: 4-[(2-benzoxy-5-bromo-benzyl)amino]-3-ethoxy-benzoic acid ethyl ester Formula: C25H26BrNO4 MolecularWeight: 484.38224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OCC)NCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OCC)NCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C25H26BrNO4/c1-3-29-24-15-19(25(28)30-4-2)10-12-22(24)27-16-20-14-21(26)11-13-23(20)31-17-18-8-6-5-7-9-18/h5-15,27H,3-4,16-17H2,1-2H3